UCSF

ZINC31977532

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 15 Yes

Other Names:

MFCD11858075

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.83 4.06 -11.34 2 4 0 53 203.245 3
Mid Mid (pH 6-8) 0.83 4.5 -31.84 3 4 1 54 204.253 3

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )